N-(5-ethanoyl-4-phenyl-1,3-thiazol-2-yl)-3-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-(5-ethanoyl-4-phenyl-1,3-thiazol-2-yl)-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(5-acetyl-4-phenyl-thiazol-2-yl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(5-acetyl-4-phenyl-2-thiazolyl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(5-acetyl-4-phenyl-1,3-thiazol-2-yl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-(5-acetyl-4-phenyl-thiazol-2-yl)-3-(p-tolylthio)propionamide Formula: C21H20N2O2S2 MolecularWeight: 396.5257

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NC2=NC(=C(S2)C(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NC2=NC(=C(S2)C(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O2S2/c1-14-8-10-17(11-9-14)26-13-12-18(25)22-21-23-19(20(27-21)15(2)24)16-6-4-3-5-7-16/h3-11H,12-13H2,1-2H3,(H,22,23,25)